The excel file contains several subtables summarizing the CHEMBL upload files.1) reference.txt contains reference paper details like title, DOI, authors2) compound_record contains the entire list of m
SI defined as i.e. the ratio of vero cell cytotoxicity to the anti-TB activity. Note: (UC) stands for Uncompetitive inhibition, (NC) Noncompetitive, (C) Competitive, (NA) Not available and (SI) Selec
Performance for different ratios between the positive and the negative cases in the training set. This file shows the performance on a balanced test set as a function of the ratio of positive and nega
(The cells were treated with 6-OAP at various concentrations for 48 h, the cell proliferation was analyzed by MTT assay, and the IC50 was calculated using the CalcuSyn software (version 2.0, Biosoft,
